5-(4-cyclopentylpiperazin-4-ium-1-yl)carbonyl-N-cyclopropyl-2-methoxy-benzenesulfonamide

Systemtic Name: 5-(4-cyclopentylpiperazin-4-ium-1-yl)carbonyl-N-cyclopropyl-2-methoxy-benzenesulfonamide Openeye Name: 5-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-N-cyclopropyl-2-methoxy-benzenesulfonamide CAS Name: 5-[(4-cyclopentyl-1-piperazin-4-iumyl)-oxomethyl]-N-cyclopropyl-2-methoxybenzenesulfonamide IUPAC Name: 5-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-N-cyclopropyl-2-methoxybenzenesulfonamide Traditional Name: 5-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-N-cyclopropyl-2-methoxy-benzenesulfonamide Formula: C20H30N3O4S+ MolecularWeight: 408.5349

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)C3CCCC3)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)C3CCCC3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C20H29N3O4S/c1-27-18-9-6-15(14-19(18)28(25,26)21-16-7-8-16)20(24)23-12-10-22(11-13-23)17-4-2-3-5-17/h6,9,14,16-17,21H,2-5,7-8,10-13H2,1H3/p+1